Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | RIPK1 | Q13546 | 2/20 | 0.41 |
| ▸ | PDE5A | O76074 | 1/20 | 0.39 |
| ▸ | HTR2A | P28223 | 1/20 | 0.37 |
| ▸ | HTR2C | P28335 | 1/20 | 0.37 |
| ▸ | HTR2B | P41595 | 1/20 | 0.37 |
| ▸ | CCR5 | P51681 | 6/20 | 0.37 |
| ▸ | MC4R | P32245 | 1/20 | 0.37 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.35 |
| ▸ | AKT1 | P31749 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL7495801 | 1.00 | RIPK1 (0.41) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7499223 | 0.88 | RIPK1 (0.39) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7545366 | 0.88 | CCR5 (0.49) | RIPK1PDE5ACCR5MC4R | |
| SCHEMBL7550997 | 0.88 | CCR5 (0.49) | RIPK1PDE5ACCR5MC4R | |
| SCHEMBL7499703 | 0.86 | RIPK1 (0.38) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7931953 | 0.86 | RIPK1 (0.38) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7603221 | 0.82 | NTRK1 (0.41) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7496849 | 0.81 | CCR5 (0.44) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7938506 | 0.81 | CCR5 (0.44) | RIPK1PDE5AHTR2AHTR2CHTR2B | |
| SCHEMBL7546571 | 0.80 | CCR5 (0.47) | CCR5 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6248755-B1 | ANTIINFLAMMATORY AGENTS; ANTIALLERGENS; AUTOIMMUNE DISEASES | MERCK & CO., INC. | 2001-06-19 | — | — | US | disclosed |